N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(4-chlorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(4-chlorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-1-(4-chlorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-2-thiophenyl]-1-(4-chlorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(4-chlorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-1-(4-chlorophenyl)sulfonyl-nipecotamide Formula: C23H20ClN3O3S3 MolecularWeight: 518.0712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H20ClN3O3S3/c24-16-7-9-17(10-8-16)33(29,30)27-12-3-4-15(14-27)21(28)26-22-18(11-13-31-22)23-25-19-5-1-2-6-20(19)32-23/h1-2,5-11,13,15H,3-4,12,14H2,(H,26,28)